3-(cyanomethyl)-2-ethyl-6-nitro-benzenecarbonitrile

Systemtic Name: 3-(cyanomethyl)-2-ethyl-6-nitro-benzenecarbonitrile Openeye Name: 3-(cyanomethyl)-2-ethyl-6-nitro-benzonitrile CAS Name: 3-(cyanomethyl)-2-ethyl-6-nitrobenzonitrile IUPAC Name: 3-(cyanomethyl)-2-ethyl-6-nitrobenzonitrile Traditional Name: 3-(cyanomethyl)-2-ethyl-6-nitro-benzonitrile Formula: C11H9N3O2 MolecularWeight: 215.20806

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1C#N)[N+](=O)[O-])CC#N

Isomeric SMILES

CCC1=C(C=CC(=C1C#N)[N+](=O)[O-])CC#N

InChI

InChI=1S/C11H9N3O2/c1-2-9-8(5-6-12)3-4-11(14(15)16)10(9)7-13/h3-4H,2,5H2,1H3